Implementation of a quantum mechanics/molecular mechanics approach in the parallel density functional program ParaGauss and applications to model copper thiolate clusters期刊界 All Journals 搜尽天下杂志传播学术成果专业期刊搜索期刊信息化学术搜索

Implementation of a quantum mechanics/molecular mechanics approach in the parallel density functional program ParaGauss and applications to model copper thiolate clusters

Authors:	T.?Kerdcharoen,U.?Birkenheuer,S.?Krüger,A.?Woiterski,N.?R?sch author-information" > author-information__contact u-icon-before" > mailto:roesch@ch.tum.de" title=" roesch@ch.tum.de" itemprop=" email" data-track=" click" data-track-action=" Email author" data-track-label=" " >Email author

Affiliation:	(1) Department of Bioengineering, Politecnico di Milano, Via Golgi, 39, 20133 Milano, Italy;(2) Department of Chemical Technology, University of Twente, The Netherlands

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